Vitas-M small molecule compound
4-({3-(methoxycarbonyl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}amino)-4-oxobutanoic acid
Catalog ID
STK433477
SMILES COC(=O)c1c(NC(=O)CCC(=O)O)sc(c1c1ccc(cc1)C(C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H23NO5S MW 389.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5S/c1-11(2)13-5-7-14(8-6-13)17-12(3)27-19(18(17)20(25)26-4)21-15(22)9-10-16(23)24/h5-8,11H,9-10H2,1-4H3,(H,21,22)(H,23,24)InChIKey
BYXKNFRGYNRJGJ-UHFFFAOYSA-NSynonyms
3(N(3(METHOXYCARBONYL)5METHYL4(4(METHYLETHYL)PHENYL)2THIENYL)CARBAMOYL)PROPANOICACID
4((3(methoxycarbonyl)5methyl4(4(propan2yl)phenyl)thiophen2yl)amino)4oxobutanoicacid
4((3METHOXYCARBONYL5METHYL4(4PROPAN2YLPHENYL)THIOPHEN2YL)AMINO)4OXOBUTANOICACID
CC1=C(C(=C(S1)NC(=O)CCC(=O)O)C(=O)OC)C2=CC=C(C=C2)C(C)C
InChI=1SC20H23NO5Sc111(2)135714(8613)1712(3)2719(18(17)20(25)264)2115(22)91016(23)24h5811H910H214H3(H2122)(H2324)
MFCD02176607
ZINC000003864135
ZINC3864135
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